HMDB0035135 RDKit 3D (E)-2,6-Dimethyl-2,5-heptadienoic acid 25 24 0 0 0 0 0 0 0 0999 V2000 -3.2691 -1.2351 -0.1194 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1537 -0.2732 0.0053 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0901 0.8398 -0.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2638 -0.3980 0.9347 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 0.5007 1.1597 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 -0.1819 1.0659 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1113 0.1682 0.1788 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8066 1.2927 -0.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4005 -0.5240 0.0947 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2308 -0.1416 -0.7686 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7038 -1.5876 0.9549 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1703 -0.7690 0.3726 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0051 -2.2077 0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5667 -1.3826 -1.1765 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3424 0.5192 -1.7498 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0549 0.9417 -1.5496 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8452 1.8138 -0.5225 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3397 -1.2308 1.6399 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1857 0.9482 2.1857 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1135 1.3434 0.4416 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4370 -1.0087 1.7262 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9597 1.0976 -1.4099 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6133 2.2440 -0.1622 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7368 1.5366 -1.3334 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3162 -2.3057 0.5672 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 2 3 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 7 9 1 0 9 10 2 0 9 11 1 0 1 12 1 0 1 13 1 0 1 14 1 0 3 15 1 0 3 16 1 0 3 17 1 0 4 18 1 0 5 19 1 0 5 20 1 0 6 21 1 0 8 22 1 0 8 23 1 0 8 24 1 0 11 25 1 0 M END